(2S)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2-methylpropylcarbamoyl)propanamide

Systemtic Name: (2S)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2-methylpropylcarbamoyl)propanamide Openeye Name: (2S)-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(isobutylcarbamoyl)propanamide CAS Name: (2S)-2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-[(2-methylpropylamino)-oxomethyl]propanamide IUPAC Name: (2S)-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2-methylpropylcarbamoyl)propanamide Traditional Name: (2S)-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]-N-(isobutylcarbamoyl)propionamide Formula: C19H24N4O3S MolecularWeight: 388.48386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3CC3

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NCC(C)C)SC1=NC2=CC=CC=C2C(=O)N1C3CC3

InChI

InChI=1S/C19H24N4O3S/c1-11(2)10-20-18(26)22-16(24)12(3)27-19-21-15-7-5-4-6-14(15)17(25)23(19)13-8-9-13/h4-7,11-13H,8-10H2,1-3H3,(H2,20,22,24,26)/t12-/m0/s1